1-[4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperazin-1-yl]ethanone

Systemtic Name: 1-[4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperazin-1-yl]ethanone CAS Name: 1-[4-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)piperazin-1-yl]ethanone Traditional Name: 1-[4-(2-nitro-4-pyrrolidinosulfonyl-phenyl)piperazino]ethanone Formula: C16H22N4O5S MolecularWeight: 382.43468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O5S/c1-13(21)17-8-10-18(11-9-17)15-5-4-14(12-16(15)20(22)23)26(24,25)19-6-2-3-7-19/h4-5,12H,2-3,6-11H2,1H3